CID 361994

136994-91-7

Structural Information

Molecular Formula
C15H11FN2S
SMILES
C1C2=NC3=CC=CC=C3N2C(S1)C4=CC=C(C=C4)F
InChI
InChI=1S/C15H11FN2S/c16-11-7-5-10(6-8-11)15-18-13-4-2-1-3-12(13)17-14(18)9-19-15/h1-8,15H,9H2
InChIKey
TUEVGHMVASKCCE-UHFFFAOYSA-N
Compound name
1-(4-fluorophenyl)-1,3-dihydro-[1,3]thiazolo[3,4-a]benzimidazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

270.06268 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 271.06996 157.0
[M+Na]+ 293.05190 170.1
[M-H]- 269.05540 163.4
[M+NH4]+ 288.09650 177.9
[M+K]+ 309.02584 164.0
[M+H-H2O]+ 253.05994 149.8
[M+HCOO]- 315.06088 174.3
[M+CH3COO]- 329.07653 170.5
[M+Na-2H]- 291.03735 159.0
[M]+ 270.06213 160.2
[M]- 270.06323 160.2
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.